In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 21 | Yes |
Popular Name: N-[[1-(difluoromethyl)imidazol-2-yl]methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine N-[[1-(difluoromethyl)imidazol-2…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.69 | 5.47 | -10.8 | 1 | 5 | 0 | 48 | 295.289 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.69 | 5.85 | -39.84 | 2 | 5 | 1 | 50 | 296.297 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.